MMs01845833 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 58 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7434 -1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0132 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5132 -2.5904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2566 -1.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7254 -1.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8898 -3.0829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5226 -3.7000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2791 -4.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 -0.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2639 -1.0388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3735 -0.0295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2091 1.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5763 2.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5857 0.9690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8423 -0.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5989 -1.6291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0989 -1.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8555 -2.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3555 -2.9090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0988 -1.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3422 -0.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8422 -0.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0856 0.9766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8807 3.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3049 4.0181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7609 4.5454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0653 6.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9454 7.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4798 6.6928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7232 7.9880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7212 9.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0946 8.5047 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9063 2.2049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9434 -1.3090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5815 -3.6403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0947 1.0499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 -3.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5795 0.5899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2608 -3.9589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9607 -3.9452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2988 -1.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9369 0.7313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6215 4.1687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1802 5.5703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6960 7.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9973 5.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5292 8.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4658 10.2803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9001 3.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8701 1.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 2 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 33 2 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 33 51 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 M END